ethyl 2-[5-methyl-7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]butanoate
Chemical Structure Depiction of
ethyl 2-[5-methyl-7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]butanoate
ethyl 2-[5-methyl-7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]butanoate
Compound characteristics
| Compound ID: | P573-7574 |
| Compound Name: | ethyl 2-[5-methyl-7-(4-methylanilino)-3-oxo[1,2,4]triazolo[4,3-a]pyrimidin-2(3H)-yl]butanoate |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C19 H23 N5 O3 |
| Smiles: | CCC(C(=O)OCC)N1C(N2C(C)=CC(Nc3ccc(C)cc3)=NC2=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7378 |
| logD: | 3.7372 |
| logSw: | -3.9347 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.653 |
| InChI Key: | GHFRRTMXRLSTMJ-HNNXBMFYSA-N |